Sugi Predict

Sugi Predict / Compounds / SCHEMBL3109529

SCHEMBL3109529

SCHEMBL3109529

CCOP(=O)(Cc1ccc(-c2ccccc2)cc1)OCC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPY5R Q15761 1/20 0.49
▸ CCNT1 O60563 2/20 0.44
▸ CDK9 P50750 2/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ KCNH2 Q12809 1/20 0.43
▸ HDAC1 Q13547 1/20 0.43
▸ POLB P06746 1/20 0.41
▸ ACHE P22303 1/20 0.41
▸ TAAR1 Q96RJ0 2/20 0.40
▸ ABCC4 O15439 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ PTGS1 P23219 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ IDO1 P14902 1/20 0.40
▸ AGXT P21549 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ NR1I2 O75469 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2493713 0.93 TSHR (0.44) NPY5RCCNT1CDK9NPSR1KCNH2
SCHEMBL28066786 0.89 NPY5R (0.43) NPY5RCCNT1CDK9NPSR1KCNH2
SCHEMBL366215 0.89 NPY5R (0.50) NPY5RCCNT1CDK9NPSR1KCNH2
Hydrogen Peroxide SCHEMBL8609887 0.87 NPY5R (0.49) NPY5RNPSR1KCNH2POLBACHE
SCHEMBL916329 0.87 NPY5R (0.49) NPY5RCCNT1CDK9NPSR1KCNH2
SCHEMBL914767 0.87 NPY5R (0.49) NPY5RCCNT1CDK9NPSR1KCNH2
SCHEMBL3375825 0.87 TSHR (0.50) NPY5RCCNT1CDK9NPSR1KCNH2
SCHEMBL11548665 0.86 RAB9A (0.56) NPY5RPOLBGAATSHRMAPT
SCHEMBL17485921 0.86 HDAC1 (0.40) NPY5RCCNT1CDK9NPSR1HDAC1
SCHEMBL20710691 0.85 KLK8 (0.43) NPY5RNPSR1KCNH2LMNAMAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220127286-A1 LIGANDS FOR NANO-SIZED MATERIALS MERCK PATENT GMBH (DE) 2022-04-28 — — US disclosed
CN-113574136-A Ligands for nanosized materials 默克专利股份有限公司 2021-10-29 — — CN disclosed
US-10770663-B2 Germanium-centered dendrimer compound, and organic optoelectric element comprising same CHUNG-ANG UNIVERSITY INDUSTRY-ACADEMIC COOPERATION FOUNDATION (KR) 2020-09-08 — — US disclosed
US-9640689-B2 Polyester film for the protection of back surfaces of solar cells TOYO BOSEKI KABUSHIKI KAISHA (JP) 2017-05-02 — — US disclosed
US-9640689-B2 Polyester film for the protection of back surfaces of solar cells TOYO BOSEKI KABUSHIKI KAISHA (JP) 2017-05-02 — — US disclosed
CN-104725356-B Nitrogen heterocyclic derivatives and application thereof in medicine 广东东阳光药业有限公司 2017-02-22 — — CN disclosed
US-20160141520-A1 GERMANIUM-CENTERED DENDRIMER COMPOUND, AND ORGANIC OPTOELECTRIC ELEMENT COMPRISING SAME CHUNG-ANG UNIVERSITY INDUSTRY-ACADEMIC COOPERATION FOUNDATION (KR) 2016-05-19 — — US disclosed
CN-104725356-A Nitrogen heterocyclic derivatives and application thereof in medicine GUANGDONG HEC PHARMACEUTICAL 2015-06-24 — — CN disclosed
US-20120183761-A1 POLYESTER FILM FOR THE PROTECTION OF BACK SURFACES OF SOLAR CELLS TOYO BOSEKI KABUSHIKI KAISHA (JP) 2012-07-19 — — US disclosed
US-7868126-B2 Process for producing polyester, polyester produced using said process, and polyester molded product TOYO BOSEKI KABUSHIKI KAISHA (JP) 2011-01-11 — — US disclosed
US-20080249280-A1 Process for Producing Polyester, Polyester Produced Using Said Process, and Polyester Molded Product TOYO BOSEKI KABUSHIKI KAISHA (JP) 2008-10-09 — — US disclosed
US-20070106055-A1 Polyester polymerization catalyst, polyester produced therewith and process for producing the polyester TOYO BOSEKI KABUSHIKI KAISHA (JP) 2007-05-10 — — US disclosed
US-20070106055-A1 Polyester polymerization catalyst, polyester produced therewith and process for producing the polyester TOYO BOSEKI KABUSHIKI KAISHA (JP) 2007-05-10 — — US disclosed
EP-0526488-B1 BENZYLPHOSPHONIC ACID TYROSINE KINASE INHIBITORS PFIZER (US) 1994-11-30 — — EP disclosed
US-5326905-A Benzylphosphonic acid tyrosine kinase inhibitors PFIZER INC. (US) 1994-07-05 — — US disclosed
EP-0526488-A1 BENZYLPHOSPHONIC ACID TYROSINE KINASE INHIBITORS. PFIZER (US) 1993-02-10 — — EP disclosed
WO-1991015495-A1 BENZYLPHOSPHONIC ACID TYROSINE KINASE INHIBITORS PFIZER INC. (US) 1991-10-17 — — WO disclosed
EP-0031796-B1 4-HETEROCYCLYL-4'-VINYL-STILBENES CIBA-GEIGY AG (CH) 1985-01-23 — — EP disclosed
US-4366189-A WHITENERS CIBA-GEIGY CORPORATION (US) 1982-12-28 — — US disclosed
EP-0031796-A2 4-Heterocyclyl-4'-vinyl-stilbenes CIBA-GEIGY AG (CH) 1981-07-08 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10770663-B2 Germanium-centered dendrimer compound, and organic optoelectric element comprising same GRK1, OCIAD2, CD40LG NPY5R 4332/4885CCNT1 1273/4885CDK9 301/4885
US-20160141520-A1 GERMANIUM-CENTERED DENDRIMER COMPOUND, AND ORGANIC OPTOELECTRIC ELEMENT COMPRISING SAME GRK1, OCIAD2, CD40LG NPY5R 4332/4885CCNT1 1273/4885CDK9 301/4885
US-20220127286-A1 LIGANDS FOR NANO-SIZED MATERIALS L1CAM, EPCAM, SELPLG NPY5R 3922/4885CCNT1 2617/4885CDK9 1982/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.